Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 12/20 | 0.67 |
| ▸ | MMP9 | P14780 | 10/20 | 0.67 |
| ▸ | MMP3 | P08254 | 10/20 | 0.67 |
| ▸ | MMP13 | P45452 | 10/20 | 0.67 |
| ▸ | MMP1 | P03956 | 9/20 | 0.67 |
| ▸ | MMP7 | P09237 | 9/20 | 0.67 |
| ▸ | MMP8 | P22894 | 1/20 | 0.53 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.52 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.52 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.52 |
| ▸ | ADAMTS4 | O75173 | 4/20 | 0.51 |
| ▸ | MMP14 | P50281 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1110930 | 0.92 | MMP2 (0.75) | MMP2MMP9MMP3MMP13MMP1 | |
| SCHEMBL1110927 | 0.92 | MMP2 (0.75) | MMP2MMP9MMP3MMP13MMP1 | |
| SCHEMBL3607214 | 0.92 | MMP2 (0.75) | MMP2MMP9MMP3MMP13MMP1 | |
| SCHEMBL15235737 | 0.86 | MMP9 (0.50) | MMP2MMP9MMP3MMP13MMP1 | |
| SCHEMBL254535 | 0.85 | MMP1 (0.65) | MMP2MMP9MMP3MMP13MMP1 | |
| SCHEMBL3608987 | 0.85 | MMP2 (0.58) | MMP2MMP9MMP3MMP13MMP1 | |
| SCHEMBL156173 | 0.81 | MMP9 (0.47) | MMP2MMP9MMP3MMP13MMP1 | |
| SCHEMBL3618803 | 0.80 | MMP2 (1.00) | MMP2MMP9MMP3MMP13MMP1 | |
| SCHEMBL4431428 | 0.80 | MMP2 (1.00) | MMP2MMP9MMP3MMP13MMP1 | |
| SCHEMBL14045736 | 0.80 | ADAMTS4 (0.64) | MMP2MMP9MMP3MMP13MMP1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012031298-A2 | ETHYNYLBENZENE DERIVATIVES | DUKE UNIVERSITY (US) | 2012-03-08 | — | — | WO | disclosed |